Basic information
- Standard SMILES
CC(=O)OC(C(Oc1ccc(Cl)cc1)n1ccnc1)C(C)(C)C- InChIKey
ZXGTTYFRMCHQNG-UHFFFAOYSA-N- Molecular formula
- C17H21ClN2O3
- Average molar mass
- 336.8 g/mol
Names & identifiers
- Preferred name
- 2-Acetoxy-1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethylbutane
- IUPAC
- [1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethylbutan-2-yl] acetate
Names & synonyms
SCHEMBL11533501ZXGTTYFRMCHQNG-UHFFFAOYSA-N2-acetoxy-1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethyl-butane2-acetoxy-1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethylbutane
Database identifiers
- PubChem CID
- 21320003
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 53.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 392
Related reactions
3 records
Linked notes
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